(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane

C120H81BrN4S2Si2 — CID 158752201

IUPAC(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane
SMILESBrc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc3c2sc2ccccc23)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc([Si](c5ccccc5)(c5ccccc5)c5cccc6c5sc5ccccc56)c4)ccc32)cc1
InChIInChI=1S/C60H40N2SSi.C30H21BrSSi.C30H20N2/c1-4-18-43(19-5-1)61-54-30-13-10-26-48(54)52-38-41(34-36-56(52)61)42-35-37-57-53(39-42)49-27-11-14-31-55(49)62(57)44-20-16-25-47(40-44)64(45-21-6-2-7-22-45,46-23-8-3-9-24-46)59-33-17-29-51-50-28-12-15-32-58(50)63-60(51)59;31-22-11-9-16-25(21-22)33(23-12-3-1-4-13-23,24-14-5-2-6-15-24)29-20-10-18-27-26-17-7-8-19-28(26)32-30(27)29;1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28/h1-40H;1-21H;1-19,31H
InChIKeyINPWOPCBXMREPX-UHFFFAOYSA-N
MW1779.21 g/mol
LogP27.57
Rot. Bonds13

About (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane

(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane (PubChem CID 158752201) has the molecular formula C120H81BrN4S2Si2 and a molecular weight of 1779.21 g/mol. Its IUPAC name is (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane.

Molecular Properties

Compound Name(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane
PubChem CID158752201
Molecular FormulaC120H81BrN4S2Si2
Molecular Weight1779.21 g/mol
Exact Mass1776.46
IUPAC Name(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane
SMILESBrc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc3c2sc2ccccc23)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc([Si](c5ccccc5)(c5ccccc5)c5cccc6c5sc5ccccc56)c4)ccc32)cc1
InChIInChI=1S/C60H40N2SSi.C30H21BrSSi.C30H20N2/c1-4-18-43(19-5-1)61-54-30-13-10-26-48(54)52-38-41(34-36-56(52)61)42-35-37-57-53(39-42)49-27-11-14-31-55(49)62(57)44-20-16-25-47(40-44)64(45-21-6-2-7-22-45,46-23-8-3-9-24-46)59-33-17-29-51-50-28-12-15-32-58(50)63-60(51)59;31-22-11-9-16-25(21-22)33(23-12-3-1-4-13-23,24-14-5-2-6-15-24)29-20-10-18-27-26-17-7-8-19-28(26)32-30(27)29;1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28/h1-40H;1-21H;1-19,31H
InChIKeyINPWOPCBXMREPX-UHFFFAOYSA-N
XLogP27.57
TPSA30.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms129
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001779.21
LogP ≤ 527.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane with MolForge

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Related Compounds

(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-dibenzothiophen-4-yl-diphenylsilane;dibenzothiophene;1,3-dibromobenzene
CID 161297195
dibenzothiophen-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397676
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-[4-[dibenzothiophen-4-yl(diphenyl)silyl]phenyl]-diphenylsilane
CID 154007181
diphenyl-bis[8-(9-phenylcarbazol-3-yl)dibenzothiophen-4-yl]silane
CID 140811711
(3-carbazol-9-ylphenyl)-[4-[dibenzothiophen-4-yl(diphenyl)silyl]phenyl]-diphenylsilane
CID 154007174
(3-carbazol-9-ylphenyl)-[6-[dibenzothiophen-4-yl(diphenyl)silyl]dibenzothiophen-4-yl]-diphenylsilane
CID 154007179
dibenzofuran-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane;dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane
CID 159706684
3-dibenzothiophen-4-yl-9H-carbazole;3-dibenzothiophen-4-yl-9-phenylcarbazole
CID 162055405
dibenzothiophen-4-yl-diphenyl-[3-[3-[9-[4-(3-triphenylen-2-ylphenyl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]silane
CID 174005488
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-[7-[dibenzothiophen-4-yl(diphenyl)silyl]triphenylen-2-yl]-diphenylsilane
CID 154007185
(3-carbazol-9-ylphenyl)-[7-[dibenzothiophen-4-yl(diphenyl)silyl]-9,9-dimethylfluoren-2-yl]-diphenylsilane
CID 154007176
(3-carbazol-9-ylphenyl)-dibenzothiophen-4-yl-diphenylsilane;methane;9-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenanthrene
CID 160677747

Frequently Asked Questions

What is the IUPAC name of (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane?
The IUPAC name of (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane (CID 158752201) is (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane.
What is the SMILES notation for (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane?
The canonical SMILES for (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane is Brc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc3c2sc2ccccc23)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc([Si](c5ccccc5)(c5ccccc5)c5cccc6c5sc5ccccc56)c4)ccc32)cc1.
What is the InChIKey of (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane?
The InChIKey is INPWOPCBXMREPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2SSi.C30H21BrSSi.C30H20N2/c1-4-18-43(19-5-1)61-54-30-13-10-26-48(54)52-38-41(34-36-56(52)61)42-35-37-57-53(39-42)49-27-11-14-31-55(49)62(57)44-20-16-25-47(40-44)64(45-21-6-2-7-22-45,46-23-8-3-9-24-46)59-33-17-29-51-50-28-12-15-32-58(50)63-60(51)59;31-22-11-9-16-25(21-22)33(23-12-3-1-4-13-23,24-14-5-2-6-15-24)29-20-10-18-27-26-17-7-8-19-28(26)32-30(27)29;1-2-8-22(9-3-1)32-29-13-7-5-11-24(29)26-19-21(15-17-30(26)32)20-14-16-28-25(18-20)23-10-4-6-12-27(23)31-28/h1-40H;1-21H;1-19,31H.
What are the key properties of (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane?
(3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane has a molecular weight of 1779.21 g/mol, XLogP of 27.57, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromophenyl)-dibenzothiophen-4-yl-diphenylsilane;3-(9H-carbazol-3-yl)-9-phenylcarbazole;dibenzothiophen-4-yl-diphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane is sourced from PubChem (CID 158752201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).